Vitas-M small molecule compound
5-bromo-N-{[4-(4-butanoylpiperazin-1-yl)phenyl]carbamothioyl}-2-methoxybenzamide
Catalog ID
STK252058
SMILES CCCC(=O)N1CCN(CC1)c1ccc(cc1)NC(=S)NC(=O)c1cc(Br)ccc1OC
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C23H27BrN4O3S MW 519.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27BrN4O3S/c1-3-4-21(29)28-13-11-27(12-14-28)18-8-6-17(7-9-18)25-23(32)26-22(30)19-15-16(24)5-10-20(19)31-2/h5-10,15H,3-4,11-14H2,1-2H3,(H2,25,26,30,32)InChIKey
QXFKYINYZAICSK-UHFFFAOYSA-NSynonyms
(5BROMO2METHOXYPHENYL)N(((4(4BUTANOYLPIPERAZINYL)PHENYL)AMINO)THIOXOMETHYL)CARBOXAMIDE
5BROMON((4(4BUTANOYLPIPERAZIN1YL)PHENYL)CARBAMOTHIOYL)2METHOXYBENZAMIDE
CCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)C3=C(C=CC(=C3)Br)OC
InChI=1SC23H27BrN4O3Sc13421(29)28131127(121428)188617(7918)2523(32)2622(30)191516(24)51020(19)312h51015H341114H212H3(H225263032)
MFCD03650248
ZINC000004121788
ZINC04121788
ZINC4121788
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